Optimal Site Charge Models for Molecular Electrostatic Potentials

DOI10.1080/08927020410001680769zbMath1057.81586OpenAlexW1969566207MaRDI QIDQ4651318

Panagiotis G. Karamertzanis, Constantinos C. Pantelides

Publication date: 21 February 2005

Published in: Molecular Simulation (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1080/08927020410001680769

zbMATH Keywords

global optimizationconfidence intervalscyclobutaneelectrostatic potentialssite charges

Mathematics Subject Classification ID

Molecular physics (81V55)

Cites Work

• Application of deterministic low-discrepancy sequences in global optimization
• Stochastic global optimization methods part I: Clustering methods
• Stochastic global optimization methods part II: Multi level methods
• On the distribution of points in a cube and the approximate evaluation of integrals

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